108 Lattice="10.650044934894535 0.0 0.0 0.0 10.650044934894535 0.0 0.0 0.0 10.650044934894535" Properties=species:S:1:pos:R:3:forces:R:3 energy=-331.79051104712966 stress="-0.00662473839379737 -1.533360345836693e-05 -0.0002988418767712761 -1.533360345836693e-05 -0.006790525741560066 0.00015853945955699925 -0.0002988418767712761 0.00015853945955699925 -0.006656186531064364" free_energy=-331.79051104712966 pbc="F F F" Cu 0.03265320 0.01180082 0.02022788 0.24817017 0.34877554 0.23353773 Cu 1.78720925 1.80531277 0.00998090 -0.04562961 -0.23314086 -0.36095105 Cu 1.74035390 0.01453585 1.74214195 0.24378045 -0.25477917 0.11829165 Cu 0.02334292 1.78272706 1.76967820 -0.43596731 -0.10937820 -0.02244687 Cu 3.56025423 0.03549037 0.03585188 -0.07255440 -0.12257267 -0.09836431 Cu 5.30150773 1.79026841 0.00630083 0.28146614 -0.06209910 -0.31884532 Cu 5.32825233 0.01957654 1.79335361 0.20015654 -0.50439795 -0.28484159 Cu 3.56928460 1.76318954 1.76126665 -0.21511625 0.19788212 0.11329250 Cu 7.13419241 0.02898133 0.02322697 -0.11855778 0.10117289 0.13471118 Cu 8.86752792 1.76491860 0.00011691 -0.11735419 0.06302078 0.22704029 Cu 8.87113210 0.03433399 1.80973953 -0.14568317 0.16815450 -0.02818459 Cu 7.07664804 1.77725561 1.78214328 0.29185224 0.14551003 -0.03824313 Cu 0.03391715 3.53121984 0.04580312 -0.02343376 0.16698390 -0.03240371 Cu 1.75522795 5.35579600 0.00716760 0.17251032 -0.33233546 -0.33998049 Cu 1.80772778 3.52155088 1.80011265 -0.18014191 0.35716164 -0.19659339 Cu 0.02072150 5.35032809 1.77694442 -0.40231605 -0.36452858 0.07190715 Cu 3.55461958 3.55931600 0.00819421 -0.12048182 0.15493985 -0.28631491 Cu 5.33691724 5.33193363 0.01014461 -0.03726862 -0.12362235 -0.28041328 Cu 5.32138725 3.58337397 1.73978079 -0.04016025 -0.25885698 0.30376148 Cu 3.51998981 5.33349738 1.80105024 0.28507560 -0.02148791 -0.13048999 Cu 7.12264874 3.55930711 0.01918146 -0.14303432 -0.17600998 -0.35155649 Cu 8.85558361 5.29288163 0.03041484 0.09031179 0.28043942 -0.14409991 Cu 8.88900407 3.58516491 1.75104787 0.24429855 -0.46389061 0.26843432 Cu 7.12854076 5.29760733 1.80960106 -0.28516725 0.25121150 -0.13466135 Cu 0.01763606 7.10327308 0.02831935 -0.13843413 0.14079901 -0.04624317 Cu 1.75930684 8.84922544 0.00458330 0.10559938 -0.13560281 0.23295832 Cu 1.75545334 7.06855804 1.74219890 0.22894649 0.58000026 0.41065318 Cu 0.00573836 8.87241493 1.81494378 0.14464333 -0.20902129 -0.10299212 Cu 3.58731281 7.08696697 0.03081305 -0.20247454 0.15918113 -0.33750668 Cu 5.29513601 8.89997568 0.01103058 0.15233458 -0.16822073 0.19266261 Cu 5.35716904 7.10482978 1.74493451 -0.17284033 -0.09552735 0.36788738 Cu 3.55120762 8.85874680 1.80615526 -0.15801637 0.23943462 -0.27549762 Cu 7.08133952 7.06530991 0.02060618 0.39724032 0.41813194 -0.23210239 Cu 8.90864818 8.84856076 0.03210942 -0.54726015 -0.53732009 0.53248884 Cu 8.88277187 7.06904006 1.80898608 0.19191919 0.35511832 -0.45949560 Cu 7.12096722 8.87004569 1.80292218 0.12970907 0.22509926 -0.43919119 Cu 0.03265789 0.00084889 3.51714896 -0.00115789 0.09771045 0.11257309 Cu 1.76007204 1.80379677 3.53846644 0.33272965 -0.35183527 0.15993768 Cu 1.79522723 0.00710286 5.29196829 -0.06330025 -0.11038505 0.05644393 Cu 0.02829724 1.79588108 5.30867296 -0.23985543 -0.22614893 0.20082611 Cu 3.58259043 0.02925418 3.52932438 -0.41537050 -0.35911262 0.11143406 Cu 5.30468403 1.74548909 3.51630378 0.28226448 0.60580531 0.29219752 Cu 5.35660943 0.03249494 5.30166171 -0.30855559 -0.39043580 0.09281449 Cu 3.56877322 1.80490491 5.34126160 -0.14740277 -0.24727587 -0.29560172 Cu 7.10137770 0.01845507 3.58172327 0.24013063 -0.33001706 -0.16732336 Cu 8.85845365 1.80653137 3.58125463 0.30624471 -0.08196443 -0.22590728 Cu 8.90639278 0.01044377 5.36401386 -0.14105789 0.08579489 -0.10788113 Cu 7.12868750 1.76525534 5.32284635 -0.19647471 0.12858940 0.12960870 Cu 0.01311474 3.53089792 3.57831730 -0.28761362 0.20380686 -0.29848896 Cu 1.77750318 5.33045769 3.52722880 0.11603875 -0.08258131 0.28810915 Cu 1.80297870 3.57533177 5.34700151 -0.12429597 -0.11675185 -0.21670856 Cu 0.00078115 5.29077695 5.29832005 -0.21163139 0.10275642 0.27494347 Cu 3.55133125 3.52238568 3.55337539 0.16417682 0.07860767 -0.03576555 Cu 5.31808605 5.28974092 3.53444001 0.05337490 0.35301065 0.12133601 Cu 5.36510096 3.52099847 5.34759379 -0.09638008 0.14210492 -0.20198336 Cu 3.57724160 5.29275593 5.29401353 -0.23874778 0.29909055 0.27896323 Cu 7.07376812 3.55850612 3.56070081 0.21627240 -0.13680236 -0.07368871 Cu 8.90195441 5.34905971 3.51819981 0.18376500 -0.31194086 0.40007802 Cu 8.84052750 3.52904524 5.36700775 0.34035717 0.33800327 -0.12738851 Cu 7.12450003 5.34803864 5.32559397 -0.26340317 -0.22390752 -0.11093203 Cu 0.01910616 7.07481125 3.57985432 -0.34794814 0.23534715 -0.17826484 Cu 1.75348325 8.89575784 3.54732014 0.14967726 0.05709197 -0.07487444 Cu 1.74303513 7.10703970 5.32791784 0.48989427 -0.23937182 0.06431968 Cu 0.04464776 8.90202651 5.30173794 -0.07497414 -0.09462627 0.14470098 Cu 3.56879131 7.12742376 3.55839143 -0.20734603 -0.33255036 -0.11432015 Cu 5.32166580 8.88089024 3.52589828 0.09484059 0.23980556 0.07340219 Cu 5.29613987 7.08563791 5.35170747 0.22827140 -0.00609260 -0.26539067 Cu 3.57216766 8.87389046 5.29240976 -0.17799209 0.28082741 0.11833900 Cu 7.08897407 7.11187664 3.54683258 -0.05218944 -0.20723215 0.06502915 Cu 8.89413833 8.85749994 3.52115850 -0.09232824 -0.11621592 0.16816285 Cu 8.85945687 7.07240601 5.32998264 0.32057085 0.34501881 -0.06679268 Cu 7.07541104 8.85673393 5.28896254 0.23793482 0.21131471 0.18083604 Cu 0.03207667 0.00218029 7.08009090 0.25469192 0.30004991 0.08224565 Cu 1.79389897 1.79549860 7.10143916 -0.20550300 -0.27546163 0.13188030 Cu 1.75507194 0.02069505 8.89825306 0.08063543 0.25711170 -0.30985308 Cu 0.01517064 1.78481318 8.89967766 0.21818208 -0.07167168 -0.27638076 Cu 3.54354492 0.02489079 7.07762761 -0.01139095 -0.27777127 0.22187526 Cu 5.32521572 1.75509315 7.09339405 0.12906121 0.18622323 0.34585943 Cu 5.29499053 0.00098152 8.88661030 0.09347532 0.23056214 -0.21725350 Cu 3.55684880 1.80754729 8.88507006 -0.07592442 -0.20685529 0.17042221 Cu 7.07170975 0.01434493 7.07038782 0.32623036 -0.27113577 0.42621223 Cu 8.89841459 1.76987541 7.10218148 0.11117408 -0.21642214 0.16815104 Cu 8.86126470 0.02452344 8.89200139 -0.42952608 0.39785965 -0.48811116 Cu 7.13488972 1.78323627 8.87718987 -0.22775135 -0.25081337 0.13263734 Cu 0.03486574 3.54785740 7.12210046 -0.48316519 -0.17346008 -0.16787444 Cu 1.76148888 5.29817240 7.13244874 0.36182738 0.40708049 -0.44838461 Cu 1.76677556 3.58396751 8.87293475 0.20868273 -0.32490047 0.41303254 Cu 0.01837124 5.29556495 8.85185696 -0.16173168 0.19907440 0.16638839 Cu 3.56218537 3.53039248 7.08064743 0.08273849 0.25761390 0.25815017 Cu 5.32849743 5.31940832 7.09883387 -0.12456378 0.00508859 -0.06529074 Cu 5.30355972 3.58170242 8.90527961 0.14412599 -0.23056079 0.10644757 Cu 3.55824345 5.33339994 8.84824831 -0.08131242 0.08567124 0.33336422 Cu 7.08714259 3.57014132 7.13003355 0.00300882 -0.18851761 -0.14714697 Cu 8.87834819 5.35473056 7.11915981 0.23728496 -0.20816870 -0.06458350 Cu 8.85426858 3.53686328 8.82738780 0.09645439 0.14370937 0.10885477 Cu 7.07643453 5.34150264 8.86623161 0.19870849 -0.09906328 0.38105210 Cu 0.02571211 7.08513375 7.11056179 -0.36386475 0.25732384 -0.04871095 Cu 1.80659466 8.87672117 7.07199481 -0.16683640 0.27473521 0.27310004 Cu 1.74367055 7.13228516 8.85914856 0.13054591 0.04850101 0.30713098 Cu 0.02092530 8.87867963 8.88609116 0.42451668 -0.39611979 -0.49483814 Cu 3.56502063 7.12119531 7.12954235 -0.14814787 -0.10959462 -0.15956454 Cu 5.32001037 8.90411006 7.06991194 0.06873803 0.10009790 0.32828611 Cu 5.35497594 7.10222374 8.89830787 -0.16243715 0.27051927 0.09607403 Cu 3.55690367 8.89659771 8.90409330 0.01834908 -0.25030019 -0.26025017 Cu 7.08043192 7.08109273 7.09930597 0.15328051 0.48675322 0.08710145 Cu 8.89624518 8.86955540 7.07486523 -0.40657815 -0.33667659 0.06791754 Cu 8.87836153 7.06749863 8.85461997 -0.22372654 0.29416063 -0.11611837 Cu 7.11518385 8.89261881 8.87225062 0.05610730 -0.33430494 -0.38077332